(5-bromofuran-2-yl)[4-(3-ethyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]methanone
Chemical Structure Depiction of
(5-bromofuran-2-yl)[4-(3-ethyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]methanone
(5-bromofuran-2-yl)[4-(3-ethyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]methanone
Compound characteristics
| Compound ID: | SC46-0618 |
| Compound Name: | (5-bromofuran-2-yl)[4-(3-ethyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]methanone |
| Molecular Weight: | 393.28 |
| Molecular Formula: | C17 H21 Br N4 O2 |
| Smiles: | CCc1nc(C2CN(CC23CCCC3)C(c2ccc(o2)[Br])=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8657 |
| logD: | 2.8649 |
| logSw: | -3.1598 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.107 |
| InChI Key: | PJMMVEIUXBJZJD-NSHDSACASA-N |